AC1L4KYD
(5R,9R,10S,13S,17R)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-6,9,11,12,16,17-hexahydro-5H-cyclopenta[a]phenanthrene-3,7-dione
Also Known As: 24-Norchola-1,14,20,22-tetraene-3,7-dione, 21,23-epoxy-4,4,8-trimethyl-, (5alpha,13alpha,17alpha)-|17-(Furan-3-yl)-4,4,8-trimethylandrosta-1,14-diene-3,7-dione|(8xi)-17alpha-(Furan-3-yl)-4,4,8-trimethyl-5alpha,13alpha-androsta-1,14-diene-3,7-dione|(5R,9R,10S,13S,17R)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-6,9,11,12,16,17-hexahydro-5H-cyclopenta[a]phenanthrene-3,7-dione
| Molecular Formula | C26H32O3 |
|---|---|
| Molecular Weight | 392.23514 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 392.23514 |
| Monoisotopic Mass | 392.23514 |
| Heavy Atoms | 29 |
| Complexity | 835.0 |
Chemical Identifiers
| CAS Number | 86558-70-5 |
|---|---|
| SMILES | C[C@@]12CC[C@@H]3[C@]4(C=CC(=O)C([C@@H]4CC(=O)C3(C1=CC[C@H]2C5=COC=C5)C)(C)C)C |
| InChIKey | KTOHAVPEOUSSID-QZWPHVGCSA-N |
Product Overview
AC1L4KYD (CAS 86558-70-5), with molecular formula C26H32O3 and molecular weight 392.23514 g/mol. IUPAC: (5R,9R,10S,13S,17R)-17-(furan-3-yl)-4,4,8,10,13-pentamethyl-6,9,11,12,16,17-hexahydro-5H-cyclopenta[a]phenanthrene-3,7-dione.
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